ChemSpider 2D Image | N-{1-[(2E)-2-{[(3Z)-2-(4-Morpholinyl)-3-(3-nitrobenzylidene)-1-cyclopenten-1-yl]methylene}hydrazino]-1-oxo-2-propanyl}-1-adamantanecarboxamide | C31H39N5O5

N-{1-[(2E)-2-{[(3Z)-2-(4-Morpholinyl)-3-(3-nitrobenzylidene)-1-cyclopenten-1-yl]methylene}hydrazino]-1-oxo-2-propanyl}-1-adamantanecarboxamide

  • Molecular FormulaC31H39N5O5
  • Average mass561.672 Da
  • Monoisotopic mass561.295105 Da
  • ChemSpider ID17131169
  • Double-bond stereo - Double-bond stereo


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

N-{1-[(2E)-2-{[(3Z)-2-(4-Morpholinyl)-3-(3-nitrobenzyliden)-1-cyclopenten-1-yl]methylen}hydrazino]-1-oxo-2-propanyl}-1-adamantancarboxamid [German] [ACD/IUPAC Name]
N-{1-[(2E)-2-{[(3Z)-2-(4-Morpholinyl)-3-(3-nitrobenzylidene)-1-cyclopenten-1-yl]methylene}hydrazino]-1-oxo-2-propanyl}-1-adamantanecarboxamide [ACD/IUPAC Name]
N-{1-[(2E)-2-{[(3Z)-2-(4-Morpholinyl)-3-(3-nitrobenzylidène)-1-cyclopentén-1-yl]méthylène}hydrazino]-1-oxo-2-propanyl}-1-adamantanecarboxamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.697
Molar Refractivity: 152.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 5.27
ACD/LogD (pH 5.5): 4.70
ACD/BCF (pH 5.5): 2207.11
ACD/KOC (pH 5.5): 8584.84
ACD/LogD (pH 7.4): 4.71
ACD/BCF (pH 7.4): 2231.49
ACD/KOC (pH 7.4): 8679.66
Polar Surface Area: 129 Å2
Polarizability: 60.4±0.5 10-24cm3
Surface Tension: 59.7±7.0 dyne/cm
Molar Volume: 395.5±7.0 cm3

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